Optical Spectra, GW, quasiparticle shifts LKU-24 V3 from job 862 (compare job 866)
1.0
17.71000000 0.00000000 0.00000000
0.00000000 17.71000000 0.00000000
0.00000000 0.00000000 17.71000000
Si O C H
69 88 59 186
Direct
0.05165339 0.03949210 0.98913637 # 1 Si1
0.22814200 0.06295825 0.43219178 # 2 Si2
0.06746187 0.17305052 0.09708136 # 3 Si3
0.31402101 0.16373769 0.30045773 # 4 Si4
0.04151779 0.13467144 0.46218003 # 5 Si5
0.22877543 0.07134460 0.91513737 # 6 Si6
0.02420447 0.31253601 0.50471214 # 7 Si7
0.24606668 0.21110891 0.79096216 # 8 Si8
0.09963155 0.40064837 0.96752803 # 9 Si9
0.23614123 0.29720441 0.37409533 # 10 Si10
0.08557876 0.56288767 0.04246332 # 11 Si11
0.26220914 0.54675575 0.09349352 # 12 Si12
0.13165682 0.42870032 0.38387477 # 13 Si13
0.26917525 0.36922535 0.90436457 # 14 Si14
0.26611042 0.54333682 0.82350436 # 15 Si15
0.06600139 0.72705562 0.97585983 # 16 Si16
0.18238546 0.80736826 0.44063913 # 17 Si17
0.04675715 0.89029992 0.10306820 # 18 Si18
0.22471597 0.85375370 0.10449115 # 19 Si19
0.02368452 0.74279125 0.48988710 # 20 Si20
0.23038063 0.70965736 0.88140673 # 21 Si21
0.03676836 0.85152461 0.63956011 # 22 Si22
0.23431050 0.80202248 0.70376279 # 23 Si23
0.41664548 0.06168599 0.01997733 # 24 Si24
0.55330832 0.07809600 0.43250031 # 25 Si25
0.41876569 0.19482805 0.14584327 # 26 Si26
0.55249161 0.16427718 0.27167230 # 27 Si27
0.37806865 0.03525575 0.54644733 # 28 Si28
0.58061104 0.06011401 0.92484215 # 29 Si29
0.35864810 0.18936742 0.64763058 # 30 Si30
0.57905507 0.20717318 0.82771362 # 31 Si31
0.42042781 0.33891407 0.02238254 # 32 Si32
0.48895408 0.38905042 0.47951347 # 33 Si33
0.61103320 0.56996246 0.23870263 # 34 Si34
0.34918105 0.28757445 0.50583421 # 35 Si35
0.56164809 0.37498940 0.90121511 # 36 Si36
0.41106300 0.50558436 0.72525496 # 37 Si37
0.57556417 0.52658560 0.78661135 # 38 Si38
0.39948125 0.72809668 0.96755520 # 39 Si39
0.51282899 0.44208261 0.30857033 # 40 Si40
0.40273233 0.88714315 0.07998034 # 41 Si41
0.56452035 0.83664094 0.10773544 # 42 Si42
0.57191174 0.70284293 0.89018359 # 43 Si43
0.39635487 0.86958714 0.63660993 # 44 Si44
0.55734011 0.79899086 0.70897613 # 45 Si45
0.75125229 0.02036531 0.99263904 # 46 Si46
0.87460862 0.07379786 0.47978665 # 47 Si47
0.82143483 0.26525665 0.08920091 # 48 Si48
0.96110430 0.29112328 0.17935531 # 49 Si49
0.71617802 0.15626323 0.53466147 # 50 Si50
0.89822744 0.01267370 0.88382846 # 51 Si51
0.69488313 0.13787919 0.71333780 # 52 Si52
0.85993870 0.15756210 0.78749358 # 53 Si53
0.69700070 0.31232523 0.98612291 # 54 Si54
0.98106103 0.42552933 0.28142184 # 55 Si55
0.75971970 0.57900126 0.13132101 # 56 Si56
0.90517925 0.58961552 0.24932277 # 57 Si57
0.83421804 0.39868587 0.36825924 # 58 Si58
0.80399811 0.31485895 0.84498172 # 59 Si59
0.72215554 0.57043632 0.67523182 # 60 Si60
0.82996737 0.43004095 0.70618252 # 61 Si61
0.72806050 0.71835203 0.00657103 # 62 Si62
0.87823918 0.72758782 0.38038412 # 63 Si63
0.73602883 0.86577784 0.12226160 # 64 Si64
0.88619237 0.81520732 0.20976005 # 65 Si65
0.74571779 0.71117510 0.52181068 # 66 Si66
0.90320366 0.71578140 0.88551981 # 67 Si67
0.73723103 0.83667030 0.65467311 # 68 Si68
0.89350713 0.85052260 0.75892778 # 69 Si69
0.05214971 0.97400948 0.05540657 # 70 O1
0.25065629 0.12273603 0.36203431 # 71 O2
0.02917630 0.11998263 0.03016922 # 72 O3
0.30626051 0.25498347 0.32712815 # 73 O4
0.96084830 0.10532090 0.50436368 # 74 O5
0.23543250 0.14805540 0.86046930 # 75 O6
0.05055714 0.22425079 0.48748250 # 76 O7
0.30325028 0.17991970 0.72223109 # 77 O8
0.13897796 0.05535678 0.95080649 # 78 O9
0.98179272 0.01476414 0.93021668 # 79 O10
0.27553627 0.46275414 0.13463112 # 80 O11
0.17101808 0.55108453 0.07917568 # 81 O12
0.20828228 0.38407408 0.35004493 # 82 O13
0.06229524 0.44000241 0.32295693 # 83 O14
0.16077491 0.51631149 0.39925529 # 84 O15
0.22127556 0.62066612 0.85464471 # 85 O16
0.20574241 0.49652106 0.76909709 # 86 O17
0.17872917 0.37153731 0.92764487 # 87 O18
0.06859766 0.65408300 0.03391170 # 88 O19
0.10228622 0.76048268 0.44493057 # 89 O20
0.95329621 0.75444137 0.43023932 # 90 O21
0.02807039 0.65436233 0.51691449 # 91 O22
0.02023434 0.79658184 0.56555194 # 92 O23
0.31699815 0.84943663 0.68434408 # 93 O24
0.15039872 0.72612578 0.93204640 # 94 O25
0.98990173 0.71231644 0.92208410 # 95 O26
0.40857133 0.97546475 0.04929333 # 96 O27
0.53548975 0.14010677 0.36222569 # 97 O28
0.43019823 0.11896796 0.09248721 # 98 O29
0.48139792 0.19459704 0.21619005 # 99 O30
0.30202081 0.04249892 0.48950564 # 100 O31
0.38411717 0.95703061 0.60079796 # 101 O32
0.60139349 0.14501364 0.89328043 # 102 O33
0.36845592 0.10689837 0.60519072 # 103 O34
0.57853637 0.29528419 0.85561593 # 104 O35
0.63805890 0.19839647 0.75676344 # 105 O36
0.49860506 0.06615797 0.97172244 # 106 O37
0.43276970 0.26821717 0.08699774 # 107 O38
0.42266024 0.41885292 0.06993311 # 108 O39
0.58877996 0.49519511 0.29063018 # 109 O40
0.68707724 0.56109989 0.18661539 # 110 O41
0.62882351 0.64154833 0.29536584 # 111 O42
0.40147386 0.36670695 0.51014158 # 112 O43
0.26930467 0.30526626 0.46114775 # 113 O44
0.32323133 0.25456720 0.58943496 # 114 O45
0.56289140 0.44363942 0.83490516 # 115 O46
0.64526131 0.53502841 0.72259730 # 116 O47
0.49931677 0.53377619 0.73506378 # 117 O48
0.48456997 0.35383589 0.95373374 # 118 O49
0.40042017 0.67380420 0.04268520 # 119 O50
0.47828210 0.86861995 0.13075637 # 120 O51
0.49105194 0.43753794 0.39978189 # 121 O52
0.25497105 0.75887168 0.47604835 # 122 O53
0.38366500 0.50328603 0.63605510 # 123 O54
0.40300005 0.80994047 0.56530384 # 124 O55
0.64780820 0.82703123 0.68525715 # 125 O56
0.47943583 0.85624894 0.68466474 # 126 O57
0.48212314 0.70744002 0.92383392 # 127 O58
0.31604337 0.71131303 0.92344158 # 128 O59
0.00063244 0.36901379 0.21034003 # 129 O60
0.01358909 0.24586000 0.11836312 # 130 O61
0.88305216 0.31599304 0.13736603 # 131 O62
0.79847401 0.11336802 0.51871486 # 132 O63
0.88671175 0.09955618 0.85448880 # 133 O64
0.71061124 0.16914034 0.62757896 # 134 O65
0.85714963 0.24216112 0.82495628 # 135 O66
0.77464435 0.13339361 0.75964485 # 136 O67
0.82006716 0.99173972 0.93297426 # 137 O68
0.66009375 0.02781993 0.96489078 # 138 O69
0.76530577 0.32720734 0.04840291 # 139 O70
0.93769212 0.50165522 0.25257859 # 140 O71
0.97931110 0.63935429 0.22353482 # 141 O72
0.83368506 0.59336926 0.18762237 # 142 O73
0.92222639 0.38345854 0.33881541 # 143 O74
0.88595609 0.47186465 0.76908424 # 144 O75
0.77870763 0.49690570 0.66544124 # 145 O76
0.73737335 0.28917386 0.90473773 # 146 O77
0.73995354 0.64631975 0.06774954 # 147 O78
0.87751803 0.78483452 0.30267881 # 148 O79
0.73079280 0.79447251 0.06082001 # 149 O80
0.80159249 0.85083113 0.18803394 # 150 O81
0.81005019 0.72343415 0.45071626 # 151 O82
0.90325719 0.78613851 0.82416188 # 152 O83
0.75999105 0.77095924 0.59271847 # 153 O84
0.96671349 0.83645699 0.70072393 # 154 O85
0.80824747 0.83869112 0.71770452 # 155 O86
0.64543945 0.71411920 0.95588053 # 156 O87
0.93528731 0.33005509 0.64229861 # 157 O88
0.31923512 0.18290982 0.19217649 # 158 C1
0.13914158 0.09066408 0.49144824 # 159 C2
0.28444124 0.30786996 0.81772334 # 160 C3
0.08004334 0.50566448 0.95465929 # 161 C4
0.09683640 0.38671427 0.47554056 # 162 C5
0.29728424 0.47322284 0.89772844 # 163 C6
0.35114617 0.57740697 0.77209091 # 164 C7
0.03895817 0.82209590 0.01815987 # 165 C8
0.31891969 0.88415720 0.14517460 # 166 C9
0.13785624 0.88663282 0.15761125 # 167 C10
0.23156975 0.79152271 0.81151219 # 168 C11
0.14297377 0.85806586 0.67263407 # 169 C12
0.46850753 0.02874218 0.48527376 # 170 C13
0.31129464 0.08833066 0.98873967 # 171 C14
0.59105028 0.59913729 0.86427300 # 172 C15
0.32421657 0.31953114 0.98241033 # 173 C16
0.39838666 0.83190567 0.98796339 # 174 C17
0.64178569 0.87543836 0.16925735 # 175 C18
0.57017635 0.78757892 0.81815314 # 176 C19
0.76485120 0.95994660 0.07888952 # 177 C20
0.62196180 0.10608117 0.51200081 # 178 C21
0.87608987 0.62660772 0.34452280 # 179 C22
0.76752155 0.35946839 0.75598835 # 180 C23
0.63901358 0.39839550 0.96889832 # 181 C24
0.96486537 0.89105210 0.18249175 # 182 C25
0.72027102 0.61138968 0.56930399 # 183 C26
0.90184261 0.95210962 0.79435793 # 184 C27
0.80715054 0.73729480 0.93423763 # 185 C28
0.38317632 0.08404438 0.31039302 # 186 C29
0.02274629 0.11419461 0.35978240 # 187 C30
0.01097560 0.32837504 0.61203994 # 188 C31
0.02036976 0.34423709 0.92766693 # 189 C32
0.14863905 0.24479884 0.35086989 # 190 C33
0.20074488 0.83108960 0.34040609 # 191 C34
0.21933843 0.89182088 0.00488554 # 192 C35
0.23521468 0.71006740 0.65200252 # 193 C36
0.45518030 0.22367823 0.66954424 # 194 C37
0.53856908 0.44625361 0.55188098 # 195 C38
0.40859961 0.21614848 0.45880550 # 196 C39
0.42894649 0.48203040 0.26004659 # 197 C40
0.56089361 0.73294128 0.12522495 # 198 C41
0.53935801 0.71158110 0.65387923 # 199 C42
0.87155234 0.97133643 0.50268487 # 200 C43
0.77237636 0.20094232 0.15698675 # 201 C44
0.71766422 0.25085453 0.48979400 # 202 C45
0.65139733 0.04261937 0.71084286 # 203 C46
0.63596691 0.23803489 0.02919606 # 204 C47
0.76189958 0.64205753 0.74083856 # 205 C48
0.89249293 0.39664298 0.62497109 # 206 C49
0.90208227 0.74598870 0.13245669 # 207 C50
0.15911117 0.21223095 0.06509766 # 208 C51
0.22421904 0.74793746 0.11236656 # 209 C52
0.59543917 0.08122190 0.22354632 # 210 C53
0.57969655 0.87136839 0.00863760 # 211 C54
0.92816472 0.15482615 0.70858972 # 212 C55
0.76329066 0.35444991 0.30452994 # 213 C56
0.28081880 0.68918791 0.44344573 # 214 C57
0.98032980 0.62072002 0.57224088 # 215 C58
0.57416175 0.66894372 0.34801770 # 216 C59
0.07539412 0.12565364 0.16646630 # 217 H1
0.02560050 0.93067707 0.61287516 # 218 H2
0.16966275 0.21921062 0.75692195 # 219 H3
0.10722452 0.38611659 0.05067638 # 220 H4
0.25973320 0.61165918 0.26127916 # 221 H5
0.26721623 0.72190306 0.07614096 # 222 H6
0.85282716 0.37080312 0.88574638 # 223 H7
0.17866024 0.87440250 0.49114563 # 224 H8
0.21070239 0.99020987 0.39398333 # 225 H9
0.24117295 0.00454418 0.86612607 # 226 H10
0.60334226 0.23084486 0.27735955 # 227 H11
0.86189813 0.22130911 0.02992280 # 228 H12
0.50113462 0.18806560 0.80583628 # 229 H13
0.54591516 0.58453290 0.18851150 # 230 H14
0.40524485 0.42802655 0.75789546 # 231 H15
0.53308533 0.36429470 0.28399268 # 232 H16
0.58768019 0.01131338 0.39367940 # 233 H17
0.56485511 0.00714149 0.86231824 # 234 H18
0.94579405 0.24018806 0.24402689 # 235 H19
0.77186447 0.09941817 0.01198915 # 236 H20
0.73845671 0.91102924 0.61683628 # 237 H21
0.95070534 0.32597137 0.46675741 # 238 H22
0.77568786 0.51047126 0.08674089 # 239 H23
0.52948811 0.31650216 0.46589203 # 240 H24
0.82974721 0.36715652 0.44592999 # 241 H25
0.81990019 0.48151523 0.37356640 # 242 H26
0.89644546 0.64225170 0.84601276 # 243 H27
0.86611105 0.08853195 0.39722440 # 244 H28
0.67399511 0.73362810 0.48409759 # 245 H29
0.28404578 0.23242369 0.17905813 # 246 H30
0.15898406 0.12683325 0.53834645 # 247 H31
0.26777635 0.34122888 0.76746229 # 248 H32
0.11889242 0.52979675 0.91234933 # 249 H33
0.07265163 0.43749334 0.50324768 # 250 H34
0.35959084 0.47632862 0.89902144 # 251 H35
0.38608485 0.60817091 0.81351832 # 252 H36
0.05796151 0.86000429 0.97221025 # 253 H37
0.33302854 0.84696930 0.19306248 # 254 H38
0.14540198 0.94374100 0.18153688 # 255 H39
0.28033209 0.82558986 0.83039759 # 256 H40
0.16248101 0.88803346 0.62099708 # 257 H41
0.50446682 0.99336376 0.52249756 # 258 H42
0.31108387 0.15062478 0.99237012 # 259 H43
0.65262981 0.59468832 0.87384055 # 260 H44
0.28796223 0.32174867 0.03323835 # 261 H45
0.44347163 0.85804948 0.95401818 # 262 H46
0.64279093 0.84460497 0.22333776 # 263 H47
0.62318047 0.81892495 0.82806730 # 264 H48
0.82732670 0.95957335 0.08155250 # 265 H49
0.58612674 0.13840529 0.55200463 # 266 H50
0.90873502 0.59384549 0.38646337 # 267 H51
0.71550671 0.39088415 0.77017155 # 268 H52
0.67438428 0.44412502 0.94608006 # 269 H53
0.99832491 0.90601558 0.23303948 # 270 H54
0.75062864 0.56616536 0.53871931 # 271 H55
0.85708308 0.98115455 0.76156723 # 272 H56
0.77629914 0.73166555 0.87990652 # 273 H57
0.29508427 0.13536486 0.15993038 # 274 H58
0.12735741 0.03529534 0.51833013 # 275 H59
0.34667865 0.30287969 0.81379561 # 276 H60
0.02287846 0.51156362 0.93043388 # 277 H61
0.14836544 0.37451023 0.50883723 # 278 H62
0.28019133 0.49532933 0.95381253 # 279 H63
0.33397395 0.61864879 0.72887962 # 280 H64
0.97727613 0.81970786 0.00930548 # 281 H65
0.31512168 0.94191596 0.16840249 # 282 H66
0.12973428 0.84832358 0.20587558 # 283 H67
0.18164048 0.82476430 0.82845637 # 284 H68
0.13762017 0.90471029 0.71423013 # 285 H69
0.44966250 0.98723118 0.44231107 # 286 H70
0.28787501 0.07012150 0.04396928 # 287 H71
0.56649450 0.57192106 0.91498296 # 288 H72
0.32340256 0.25949541 0.96560204 # 289 H73
0.34608550 0.85241317 0.96139571 # 290 H74
0.63279056 0.93547650 0.18255434 # 291 H75
0.52584460 0.82310140 0.84397085 # 292 H76
0.74850851 0.99850757 0.12552939 # 293 H77
0.62651910 0.04992822 0.53952798 # 294 H78
0.81692475 0.60913518 0.35326593 # 295 H79
0.74967869 0.31493578 0.71627552 # 296 H80
0.61433413 0.41850404 0.02233131 # 297 H81
0.93166191 0.94271053 0.17064006 # 298 H82
0.66166536 0.60696034 0.54781626 # 299 H83
0.95481329 0.97198017 0.76774107 # 300 H84
0.81065293 0.79941496 0.94101543 # 301 H85
0.40241067 0.07273523 0.36779802 # 302 H86
0.34612273 0.03643856 0.29406253 # 303 H87
0.43066748 0.08349259 0.27124047 # 304 H88
0.07327310 0.11592525 0.32411510 # 305 H89
0.99898088 0.05682385 0.35586816 # 306 H90
0.98064827 0.15291664 0.33561930 # 307 H91
0.03946271 0.28184628 0.64215929 # 308 H92
0.04075381 0.38088725 0.62884888 # 309 H93
0.96697401 0.35842348 0.95608401 # 310 H94
0.01360273 0.35563945 0.86691801 # 311 H95
0.02952342 0.28325390 0.93470322 # 312 H96
0.15139900 0.23366374 0.28962137 # 313 H97
0.14425489 0.19062934 0.37900474 # 314 H98
0.09732608 0.27770110 0.36109093 # 315 H99
0.15904199 0.87230872 0.32022029 # 316 H100
0.25714499 0.85601431 0.33305209 # 317 H101
0.19650219 0.78037525 0.30476478 # 318 H102
0.16541498 0.91977228 0.99383137 # 319 H103
0.26376297 0.93412114 0.99559093 # 320 H104
0.22616707 0.84772068 0.96207220 # 321 H105
0.19525390 0.67116548 0.67954859 # 322 H106
0.21745292 0.71760346 0.59314375 # 323 H107
0.29139197 0.68379492 0.65116443 # 324 H108
0.49142748 0.17886101 0.69177619 # 325 H109
0.48110618 0.24426166 0.61691266 # 326 H110
0.45526672 0.27088052 0.70981386 # 327 H111
0.54222933 0.41705270 0.60656372 # 328 H112
0.51210722 0.50157723 0.56129281 # 329 H113
0.59666339 0.45590762 0.53185135 # 330 H114
0.43128112 0.23602366 0.40484798 # 331 H115
0.45693219 0.20178828 0.49491899 # 332 H116
0.37658087 0.16417512 0.44898790 # 333 H117
0.41398934 0.53731485 0.28424194 # 334 H118
0.43986336 0.48974955 0.19947767 # 335 H119
0.37985413 0.44458242 0.26683469 # 336 H120
0.53846820 0.72604820 0.18283137 # 337 H121
0.52313640 0.70188648 0.08723372 # 338 H122
0.61686013 0.70646273 0.12400966 # 339 H123
0.48430213 0.68711289 0.66870719 # 340 H124
0.53814914 0.72470209 0.59319265 # 341 H125
0.58275009 0.66860334 0.66448760 # 342 H126
0.81716290 0.94650280 0.48585834 # 343 H127
0.91680040 0.94059806 0.47321201 # 344 H128
0.87900377 0.96181392 0.56362236 # 345 H129
0.74112007 0.15619491 0.12769241 # 346 H130
0.81461097 0.17356782 0.19358661 # 347 H131
0.73272312 0.23192445 0.19330914 # 348 H132
0.66481253 0.28132426 0.50157236 # 349 H133
0.76503941 0.28466519 0.51122894 # 350 H134
0.72346423 0.24619443 0.42815223 # 351 H135
0.65039949 0.01681400 0.76725060 # 352 H136
0.59295240 0.04444060 0.68987969 # 353 H137
0.68369702 0.00487784 0.67363728 # 354 H138
0.66267650 0.18214446 0.02828262 # 355 H139
0.62716422 0.25463648 0.08849461 # 356 H140
0.58037359 0.23300097 0.00271835 # 357 H141
0.77589639 0.61570534 0.79524559 # 358 H142
0.81354614 0.66734839 0.71759967 # 359 H143
0.72116260 0.68788277 0.75088108 # 360 H144
0.93073804 0.44527549 0.61476671 # 361 H145
0.85960703 0.38908019 0.57233951 # 362 H146
0.86592085 0.69634141 0.13128799 # 363 H147
0.88830531 0.78057821 0.08253353 # 364 H148
0.96109659 0.72856655 0.12811064 # 365 H149
0.20317798 0.16874244 0.06442814 # 366 H150
0.15465226 0.23628947 0.00805866 # 367 H151
0.17708283 0.25746323 0.10362505 # 368 H152
0.00947066 0.61758569 0.18303841 # 369 H153
0.16936931 0.72241552 0.09914878 # 370 H154
0.23802528 0.73297384 0.17119496 # 371 H155
0.61012518 0.09555858 0.16494009 # 372 H156
0.64670612 0.06249361 0.25324222 # 373 H157
0.55557779 0.03356022 0.22207315 # 374 H158
0.55416264 0.92773979 0.00438839 # 375 H159
0.63905745 0.87589385 0.99227004 # 376 H160
0.55199018 0.83498464 0.96719128 # 377 H161
0.92980264 0.09893565 0.68162507 # 378 H162
0.91370733 0.19703027 0.66549042 # 379 H163
0.98522988 0.16776811 0.72954179 # 380 H164
0.76825284 0.37674268 0.24677951 # 381 H165
0.77030210 0.29283617 0.30241780 # 382 H166
0.70592536 0.36695994 0.32495281 # 383 H167
0.23294288 0.65280801 0.42747311 # 384 H168
0.31577891 0.70017013 0.39312801 # 385 H169
0.31537628 0.65984419 0.48587038 # 386 H170
0.97488830 0.65645696 0.62294266 # 387 H171
0.92342365 0.60963701 0.54938334 # 388 H172
0.00567728 0.56653325 0.58889887 # 389 H173
0.21149120 0.51936943 0.41988953 # 390 H174
0.18398897 0.52324674 0.72646070 # 391 H175
0.88710490 0.44842356 0.81883114 # 392 H176
0.38955552 0.45701463 0.60682660 # 393 H177
0.35617188 0.80126911 0.53720863 # 394 H178
0.23147225 0.43294729 0.14939114 # 395 H179
0.37987147 0.42663692 0.10409604 # 396 H180
0.36057756 0.63626956 0.05164945 # 397 H181
0.52098998 0.68487523 0.31952956 # 398 H182
0.59769216 0.71931822 0.37545956 # 399 H183
0.56151649 0.62643639 0.39178003 # 400 H184
0.03149229 0.53658243 0.10145315 # 401 H185
0.22774043 0.59388275 0.28298127 # 402 H371